데이터를 보충하는 중입니다. 잠시 후 페이지를 새로 고치면 최신 내용을 볼 수 있습니다
기본 정보
- CAS
1172623-96-9- 표준 SMILES
C#CCC(NC(=O)OC(C)(C)C)C(=O)c1cc(F)ccc1F- InChIKey
FCPUEOMVOKWZQD-UHFFFAOYSA-N- 분자식
- C16H17F2NO3
- 평균 분자량
- 309.312 g/mol
- 단동위원소 질량
- 309.11764984
이름 및 식별자
- 우선 이름
- 1,1-Dimethylethyl N-[1-(2,5-difluorobenzoyl)-3-butyn-1-yl]carbamate
- IUPAC
- tert-Butyl [1-(2,5-difluorophenyl)-1-oxopent-4-yn-2-yl]carbamate
- 영어명
- tert-butyl 1-(2,5-difluorophenyl)-1-oxopent-4-yn-2-ylcarbaMate
- 분자식
- C16H17F2NO3
- 분자량
- 309.31
이름 및 동의어
TB-21232-(Boc-amino)-1-(2,5-difluorophenyl)-4-pentyn-1-onetert-butyl 1-(2,5-difluorophenyl)-1-oxopent-4-yn-2-ylcarbaMatetert-butyl[1-(2,5-difluorophenyl)-1-oxopent-4-yn-2-yl]carbam...tert-Butyl [1-(2,5-difluorophenyl)-1-oxo-4-pentyn-2-yl]carbamatetert-butyl N-[1-(2,5-difluorophenyl)-1-oxopent-4-yn-2-yl]carbamateCarbamic acid, N-[1-(2,5-difluorobenzoyl)-3-butyn-1-yl]-, 1,1-dimethylethyl ester
데이터베이스 식별자
- CAS
1172623-96-9- PubChem CID
- 57788657
- DTXSID
DTXSID501162634
물성
물리화학적 성질
- 끓는 점
- 429.7 · 429.7±45.0 °C(Predicted)
- 밀도
- 1.199 · 1.199±0.06 g/cm3(Predicted)
- 저장 조건
- 2 · 2-8°C
- 산도 계수 (pKa)
- 10.2 · 10.20±0.46(Predicted)
- InChI
- InChI=1S/C16H17F2NO3/c1-5-6-13(19-15(21)22-16(2,3)4)14(20)11-9-10(17)7-8-12(11)18/h1,7-9,13H,6H2,2-4H3,(H,19,21)
- InChIKey
- FCPUEOMVOKWZQD-UHFFFAOYSA-N
- SMILES
- C(OC(C)(C)C)(=O)NC(C(=O)C1=CC(F)=CC=C1F)CC#C
화학 및 산업
응용 분야
용도tert-Butyl (1-(2,5-Difluorophenyl)-1-oxopent-4-yn-2-yl)carbamate is used as a reactant in the preparation of a highly functionalized tetrahydropyran DPP-4 inhibitor.
공급사56 곳
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海药诚医药科技合伙企业（有限合伙）400-6181121 18616381138 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
学研惠（武汉）科技有限公司15727060112 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
湖北魏氏化学试剂股份有限公司17771898297 13125137661 · [email protected]
Aceschem Inc.+1-817863-6948 +1-（817）863-6948 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]
广州科瑞生物技术有限公司20-66003216 18666003216 · [email protected]
台州南峰药物研究所[email protected] 13127117265 · [email protected]
上海磐索医药科技有限公司021-20962833 15316628753 · [email protected]
上海喀露蓝科技有限公司18149758185 18149758185 · [email protected]
관련 반응
4건
화합물 노트
불러오는 중…